{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.360944 2.643853 2.165766 ] [ 2.694587 4.80447 3.102481 ] [ 4.665525 1.923814 2.374826 ] [ 4.545146 3.928705 1.722535 ] [ 3.943017 3.203445 4.218269 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.360944e-10 2.643853e-10 2.165766e-10 ] [ 2.694587e-10 4.80447e-10 3.102481e-10 ] [ 4.665525e-10 1.923814e-10 2.374826e-10 ] [ 4.545146e-10 3.928705e-10 1.722535e-10 ] [ 3.943017e-10 3.203445e-10 4.218269e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -36.1083067 -39.6202502 -15.4715544 ] [ 0.1258785 9.6836813 -7.6067693 ] [ -17.7863957 -42.7241724 14.9047843 ] [ 33.0258484 78.7134167 -33.8898231 ] [ 20.7429756 -6.0526755 42.0633625 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.785188528804564e-08 -6.347863910367382e-08 -2.478816295133989e-08 ] [ 2.01679591422969e-10 1.551496790996274e-08 -1.218738803268853e-08 ] [ -2.849694759361807e-08 -6.845167072626769e-08 2.388009714027004e-08 ] [ 5.291324262450628e-08 1.261127970190454e-07 -5.429748270121344e-08 ] [ 3.323391082595213e-08 -9.697455259284266e-09 6.73929365449718e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 20.408501 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.269802343716563e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9023454 2.3518301 1.9818875 ] [ 2.5859578 4.9607109 3.0725678 ] [ 4.6977309 1.6410042 2.3609847 ] [ 4.8937362 4.3796185 1.3993498 ] [ 4.1294488 3.1711232 4.7690872 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9023454e-10 2.3518301e-10 1.9818875e-10 ] [ 2.5859578e-10 4.9607109e-10 3.0725678e-10 ] [ 4.6977309e-10 1.6410042e-10 2.3609847e-10 ] [ 4.8937362e-10 4.3796185e-10 1.3993498e-10 ] [ 4.1294488e-10 3.1711232e-10 4.7690872e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 -0.0 8e-07 ] [ -6e-07 2e-07 -4e-07 ] [ 0.0 -2e-07 -6e-07 ] [ 4e-07 -3e-07 1.5e-06 ] [ 2e-07 4e-07 -1.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 1.2817413072e-15 ] [ -9.613059803999998e-16 3.204353268e-16 -6.408706536e-16 ] [ 0.0 -3.204353268e-16 -9.613059803999998e-16 ] [ 6.408706536e-16 -4.806529901999999e-16 2.403264951e-15 ] [ 3.204353268e-16 6.408706536e-16 -1.9226119608e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.147671 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.946271463371942e-18 } }